5-(Chloromethyl)-1-propylpyrazolo[1,5-a]pyrimidin-7-one - CAS 1018165-86-0
Catalog: |
BB042892 |
Product Name: |
5-(Chloromethyl)-1-propylpyrazolo[1,5-a]pyrimidin-7-one |
CAS: |
1018165-86-0 |
Synonyms: |
5-(Chloromethyl)-1-propylpyrazolo[1,5-a]pyrimidin-7(1H)-one; SBB025992; STK352917; ZINC12398302 |
IUPAC Name: | 5-(chloromethyl)-1-propylpyrazolo[1,5-a]pyrimidin-7-one |
Description: | 5-(Chloromethyl)-1-propylpyrazolo[1,5-a]pyrimidin-7-one (CAS# 1018165-86-0 ) is a useful research chemical. |
Molecular Weight: | 225.67 |
Molecular Formula: | C10H12ClN3O |
Canonical SMILES: | CCCN1C=CC2=NC(=CC(=O)N21)CCl |
InChI: | InChI=1S/C10H12ClN3O/c1-2-4-13-5-3-9-12-8(7-11)6-10(15)14(9)13/h3,5-6H,2,4,7H2,1H3 |
InChI Key: | YBHLPNRBYYLHNT-UHFFFAOYSA-N |
Complexity: | 373 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 225.0668897 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 225.0668897 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 35.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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